4UAZ

DNA polymerase beta reactant complex with a templating adenine and incoming 8-oxodGTP, 20 s

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-BM
Synchrotron site	APS
Beamline	22-BM
Temperature [K]	100
Detector technology	CCD
Collection date	2013-06-27
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	50.835, 79.921, 55.420
Unit cell angles	90.00, 107.64, 90.00

Refinement procedure

Resolution	31.867 - 1.880
R-factor	0.1814
Rwork	0.179
R-free	0.21960
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2fms
RMSD bond length	0.019
RMSD bond angle	0.950
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.910
High resolution limit [Å]	1.880	1.880
Rmerge	0.055	0.340
Number of reflections	56411
<I/σ(I)>	23.3	2.3
Completeness [%]	95.6	68.9
Redundancy	3.3	1.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8	291	50 mM imidazole, 350 mM sodium chloride, 17% PEG3350, pH 8.0